Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.53 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | PLAU | P00749 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MASP2 | O00187 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
| ▸ | F2 | P00734 | 12/20 | 0.41 |
| ▸ | F10 | P00742 | 9/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.41 |
| ▸ | C1S | P09871 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | ST14 | Q9Y5Y6 | 2/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1244509 | 0.88 | ALDH1A1 (0.67) | ALDH1A1PRMT5PRMT1HPGDCYP2C19 | |
| Hydrochloric Acid SCHEMBL29182256 | 0.86 | ALDH1A1 (0.64) | ALDH1A1PRMT5PRMT1HPGDCYP2C19 | |
| Acrylonitrile SCHEMBL20767466 | 0.79 | ALDH1A1 (0.65) | ALDH1A1LMNAKMT2A | |
| Guanidine SCHEMBL27983197 | 0.75 | ALDH1A1 (0.65) | ALDH1A1PRMT5PRMT1HPGDCYP2C19 | |
| 4-Vinylphenol SCHEMBL11869928 | 0.74 | ALDH1A1 (0.50) | ALDH1A1HPGDHSD17B10KMT2APKM | |
| SCHEMBL24167565 | 0.71 | ALDH1A1 (0.58) | ALDH1A1PRMT5PRMT1HPGDCYP2C19 | |
| Stilbamidine SCHEMBL889782 | 0.71 | PRMT1 (1.00) | ALDH1A1PRMT5PRMT1HPGDCYP2C19 | |
| Stilbamidine SCHEMBL208655 | 0.71 | PRMT1 (1.00) | ALDH1A1PRMT5PRMT1HPGDCYP2C19 | |
| Acrylonitrile SCHEMBL8511289 | 0.70 | ALDH1A1 (0.50) | ALDH1A1HPGDCYP2C19HSD17B10RECQL | |
| SCHEMBL537030 | 0.69 | LMNA (0.77) | ALDH1A1PRMT5PRMT1HPGDCYP2C19 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2709476-B1 | MOLECULARLY IMPRINTED POLYMERS FOR TREATING TOBACCO MATERIAL AND FILTERING SMOKE FROM SMOKING ARTICLES | REYNOLDS TOBACCO CO R (US) | 2016-09-21 | — | — | EP | disclosed |
| EP-2709476-A2 | MOLECULARLY IMPRINTED POLYMERS FOR TREATING TOBACCO MATERIAL AND FILTERING SMOKE FROM SMOKING ARTICLES | R. J. Reynolds Tobacco Company (US) | 2014-03-26 | — | — | EP | disclosed |
| WO-2012158915-A2 | MOLECULARLY IMPRINTED POLYMERS FOR TREATING TOBACCO MATERIAL AND FILTERING SMOKE FROM SMOKING ARTICLES | R. J. REYNOLDS TOBACCO COMPANY (US) | 2012-11-22 | — | — | WO | disclosed |